N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide

C16H25N3O2S — CID 119829137

IUPACN-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide
SMILESO=C(NCC(c1cccs1)N1CCOCC1)C1CCCNC1
InChIInChI=1S/C16H25N3O2S/c20-16(13-3-1-5-17-11-13)18-12-14(15-4-2-10-22-15)19-6-8-21-9-7-19/h2,4,10,13-14,17H,1,3,5-9,11-12H2,(H,18,20)
InChIKeyHCYSCXDLTWZDKT-UHFFFAOYSA-N
MW323.46 g/mol
LogP1.24
Rot. Bonds5

About N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide

N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide (PubChem CID 119829137) has the molecular formula C16H25N3O2S and a molecular weight of 323.46 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide
PubChem CID119829137
Molecular FormulaC16H25N3O2S
Molecular Weight323.46 g/mol
Exact Mass323.17
IUPAC NameN-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide
SMILESO=C(NCC(c1cccs1)N1CCOCC1)C1CCCNC1
InChIInChI=1S/C16H25N3O2S/c20-16(13-3-1-5-17-11-13)18-12-14(15-4-2-10-22-15)19-6-8-21-9-7-19/h2,4,10,13-14,17H,1,3,5-9,11-12H2,(H,18,20)
InChIKeyHCYSCXDLTWZDKT-UHFFFAOYSA-N
XLogP1.24
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.46
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]piperidine-3-carboxamide
CID 119872524
(2S,4S)-2-methyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-4-carboxamide
CID 120631423
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)spiro[2.5]octane-7-carboxamide
CID 154865751
(3R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,1-dioxothiolane-3-carboxamide
CID 30468496
N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyrrolidine-1-carboxamide
CID 94494130
N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119849719
(4S)-2-oxo-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-ylethyl]imidazolidine-4-carboxamide
CID 97078921
(4R)-2-oxo-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-ylethyl]imidazolidine-4-carboxamide
CID 97078923
(3R)-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide
CID 81123819
(1R)-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 39982815
N-(2-thiophen-2-ylethyl)piperidine-3-carboxamide;hydrochloride
CID 119270431
N-(2-morpholin-4-yl-2-phenylethyl)cyclobutanecarboxamide
CID 42948395

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide?
The IUPAC name of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide (CID 119829137) is N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide?
The canonical SMILES for N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide is O=C(NCC(c1cccs1)N1CCOCC1)C1CCCNC1.
What is the InChIKey of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide?
The InChIKey is HCYSCXDLTWZDKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2S/c20-16(13-3-1-5-17-11-13)18-12-14(15-4-2-10-22-15)19-6-8-21-9-7-19/h2,4,10,13-14,17H,1,3,5-9,11-12H2,(H,18,20).
What are the key properties of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide?
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide has a molecular weight of 323.46 g/mol, XLogP of 1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)piperidine-3-carboxamide is sourced from PubChem (CID 119829137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).